SCHEMBL12993151

SCHEMBL12993151

Cc1ccc(CCc2ccc(C)c(F)c2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2A6 P11509 1/20 0.42
CHKA P35790 1/20 0.40
KCNH2 Q12809 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
IDO1 P14902 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ACHE P22303 1/20 0.34
IGF1R P08069 1/20 0.34
ALOX15 P16050 1/20 0.34
DAO P14920 2/20 0.34
MAPT P10636 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18503375 0.95 CYP1A2 (0.38) TAAR1CYP1A2CYP2A6CHKAKCNH2
SCHEMBL20373892 0.90 TAAR1 (0.39) TAAR1CYP1A2CYP2A6CHKAKCNH2
SCHEMBL27073675 0.85 P2RX7 (0.36) TAAR1ACHE
SCHEMBL21182741 0.84 HRH3 (0.31) TAAR1CYP1A2CYP2A6CHKAHRH3
SCHEMBL18901756 0.83 TAAR1 (0.39) TAAR1PTGS1PTGS2DAO
SCHEMBL19887710 0.82 RET (0.37) TAAR1CYP1A2CYP2A6IDO1ACHE
SCHEMBL19197845 0.82 HRH3 (0.37) PTGS1PTGS2HRH3
SCHEMBL19197050 0.82 CYP2A6 (0.36) TAAR1CYP1A2CYP2A6PTGS1PTGS2
SCHEMBL18511911 0.81 DAO (0.48) TAAR1PTGS1PTGS2DAO
SCHEMBL17897369 0.81 SRD5A2 (0.37) TAAR1CYP1A2CYP2A6IDO1ACHE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287272-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DEVICE DIC CORPORATION (JP) 2023-09-14 US disclosed
US-11739270-B2 Polymerizable compound as well as liquid crystal composition and liquid crystal display device each including polymerizable compound DIC CORPORATION (JP) 2023-08-29 US disclosed
US-11639327-B2 Polymerizable compound, and liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2023-05-02 US disclosed
US-20200255737-A1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2020-08-13 US disclosed
US-10711197-B2 Liquid-crystalline medium and high-frequency components comprising same MERCK PATENT GMBH (DE) 2020-07-14 US disclosed
US-20180208846-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME DIC CORPORATION (JP) 2018-07-26 US disclosed
US-20180187079-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-07-05 US disclosed
US-20180105748-A1 LIQUID-CRYSTALLINE MEDIUM, COMPOUNDS, AND HIGH-FREQUENCY COMPONENTS MERCK PATENT GMBH (DE) 2018-04-19 US disclosed
US-20170253800-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2017-09-07 US disclosed
US-20170218270-A1 LIQUID-CRYSTAL DISPLAY DIC CORPORATION (JP) 2017-08-03 US disclosed
US-20170218271-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2017-08-03 US disclosed
US-20170210988-A1 LIQUID-CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2017-07-27 US disclosed
US-20170130129-A1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2017-05-11 US disclosed
US-7854970-B2 Liquid-crystalline medium MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-12-21 US disclosed
US-20100051864-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT (DE) 2010-03-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11739270-B2 Polymerizable compound as well as liquid crystal composition and liquid crystal display device each including polymerizable compound OCIAD2, PKN2, SKP1 TAAR1 2597/4885CYP1A2 2601/4885CYP2A6 1463/4885
US-11639327-B2 Polymerizable compound, and liquid crystal composition and liquid crystal display device using the same SKP1, PKN1, KTN1 TAAR1 3433/4885CYP1A2 3295/4885CYP2A6 4156/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.